SCHEMBL6954155

SCHEMBL6954155

CCNC(Cc1ccc(OCCN2COc3ccccc3C2=O)cc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.43
PPARA Q07869 6/20 0.43
ITGB3 P05106 3/20 0.41
ITGA2B P08514 3/20 0.41
PPARD Q03181 1/20 0.41
ITGB1 P05556 2/20 0.41
ITGA4 P13612 2/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6948917 0.91 PPARG (0.40) PPARGPPARAITGB3ITGA2BPPARD
SCHEMBL7248373 0.84 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL6952576 0.84 PPARG (0.45) PPARGPPARAPPARD
SCHEMBL6952000 0.82 ITGB3 (0.41) PPARGPPARAITGB3ITGA2BPPARD
Hydrochloric Acid SCHEMBL6944979 0.80 PPARG (0.41) PPARGPPARAPPARD
SCHEMBL7248494 0.80 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL6955086 0.80 PPARG (0.36) PPARGPPARAITGB3ITGA2BITGB1
SCHEMBL6952568 0.80 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL6948555 0.80 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL6956385 0.79 PPARG (0.42) PPARGPPARAPPARD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0903343-B1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP CO LTD (JP) 2003-05-28 EP disclosed
EP-0903343-A1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP Co., Ltd. (JP) 1999-03-24 EP disclosed